Two predicted two-dimensional BCN structures: A first-principles study
Yihua Lu, Yunduo Yu, Xi Zhu, Min Wang
Topics & Concepts
PhononThermal stabilityStiffnessMaterials scienceSemiconductorAb initioDispersion (optics)Stability (learning theory)Band gapCondensed matter physicsThermalMolecular dynamicsPlane (geometry)Molecular physicsThermodynamicsChemical physicsCrystallographyComputational chemistryChemistryPhysicsOptoelectronicsOpticsComposite materialMathematicsQuantum mechanicsComputer scienceMachine learningGeometryBoron and Carbon Nanomaterials ResearchMXene and MAX Phase MaterialsGraphene research and applications